N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine

C14H28N2O — CID 79408501

IUPACN-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine
SMILESCCC1COCCN1C(C)C(C)CNC1CC1
InChIInChI=1S/C14H28N2O/c1-4-14-10-17-8-7-16(14)12(3)11(2)9-15-13-5-6-13/h11-15H,4-10H2,1-3H3
InChIKeyHFPYGTNBIDDCPK-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.87
Rot. Bonds6

About N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine

N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine (PubChem CID 79408501) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine.

Molecular Properties

Compound NameN-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine
PubChem CID79408501
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine
SMILESCCC1COCCN1C(C)C(C)CNC1CC1
InChIInChI=1S/C14H28N2O/c1-4-14-10-17-8-7-16(14)12(3)11(2)9-15-13-5-6-13/h11-15H,4-10H2,1-3H3
InChIKeyHFPYGTNBIDDCPK-UHFFFAOYSA-N
XLogP1.87
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
CID 62431858
3-(3-ethylmorpholin-4-yl)-N,2-dimethylbutan-1-amine
CID 79408287
N-[3-(2-ethylpiperidin-1-yl)-2-methylbutyl]cyclopropanamine
CID 79408489
N-[3-(3-ethylmorpholin-4-yl)-2-methylpropyl]cyclopropanamine
CID 62432403
2-(3-ethylmorpholin-4-yl)-N-propan-2-ylpropan-1-amine
CID 62431857
2-(3-ethylmorpholin-4-yl)-N,3-dimethylbutan-1-amine
CID 62432213
2-(3-ethylmorpholin-4-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 62570658
N-[2-methyl-3-(4-propan-2-ylazepan-1-yl)butyl]cyclopropanamine
CID 79409298
N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
CID 60867675
N-[3-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-methylbutyl]cyclopropanamine
CID 79409085
2-(3-ethylmorpholin-4-yl)pentan-1-amine
CID 43612958
N-[4-(3-ethylmorpholin-4-yl)butyl]cyclopropanamine
CID 62432568

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine?
The IUPAC name of N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine (CID 79408501) is N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine.
What is the SMILES notation for N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine?
The canonical SMILES for N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine is CCC1COCCN1C(C)C(C)CNC1CC1.
What is the InChIKey of N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine?
The InChIKey is HFPYGTNBIDDCPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-14-10-17-8-7-16(14)12(3)11(2)9-15-13-5-6-13/h11-15H,4-10H2,1-3H3.
What are the key properties of N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine?
N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine has a molecular weight of 240.39 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-ethylmorpholin-4-yl)-2-methylbutyl]cyclopropanamine is sourced from PubChem (CID 79408501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).